RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 6.8342 -1.1352 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3412 -1.3191 -1.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7145 -0.0839 -0.8622 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2576 -0.2670 -0.6462 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 -0.6891 0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1585 -0.6367 -0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1336 -0.2103 -1.3414 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4464 0.0253 -1.6954 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -0.9811 0.5976 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0139 -1.5454 2.0107 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0698 -0.3163 2.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6952 0.7848 2.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0954 0.1836 0.8600 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.2787 1.1726 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4501 2.0514 -0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4035 3.3776 0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 3.7822 0.5283 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5725 2.7985 0.3224 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8439 1.7548 -0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5709 0.4082 -0.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9918 -0.7166 -1.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9432 -1.7557 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -1.3866 -0.9399 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 0.2035 -0.3222 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2621 -2.0302 -2.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0313 -0.2845 -2.3881 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3524 -0.9621 -0.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -1.5275 -2.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1767 -2.1996 -0.8741 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8825 0.7959 -1.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2002 0.1203 0.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8594 -0.9985 1.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6916 -1.6882 -0.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8352 -2.2214 2.1494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9208 -2.1101 2.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3456 -0.5133 3.8992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1121 -0.0104 3.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6089 1.0788 2.7075 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0593 1.6570 1.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0198 -0.2404 1.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3608 1.7673 -0.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4002 0.6143 -1.1942 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5842 4.0628 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0497 4.6983 0.7934 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9548 -0.8239 -1.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7118 -2.7184 -1.7457 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1277 -1.9658 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 8 4 1 0 13 9 1 0 19 15 1 0 24 20 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 5 32 1 0 9 33 1 6 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 17 44 1 0 21 45 1 0 22 46 1 0 23 47 1 0 M CHG 1 13 1 M END